Bioactive Compound Details

BioIDbio199132
NameNone
ChEMBL IDCHEMBL399997
Molecular FormulaC13H10BrNO2S
Molecular Weight324.2
Molecular Weight (Monoisotopic)322.9616
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-Bromobenzyl 6-Mercaptopicolinate
SmilesO=C(OCc1ccccc1Br)c1cccc(S)n1
InchiInChI=1S/C13H10BrNO2S/c14-10-5-2-1-4-9(10)8-17-13(16)11-6-3-7-12(18)15-11/h1-7H,8H2,(H,15,18)
Inchi KeyBYAIZTJWUFLESC-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities4.0
Np Likeness Score-1.08
Records Key['4-21']
Records Name['2-bromobenzyl 6-mercaptopicolinate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure